CID 170728

2-ethyl-2-methyl-2,3-dihydroperimidine

Structural Information

Molecular Formula
C14H16N2
SMILES
CCC1(NC2=CC=CC3=C2C(=CC=C3)N1)C
InChI
InChI=1S/C14H16N2/c1-3-14(2)15-11-8-4-6-10-7-5-9-12(16-14)13(10)11/h4-9,15-16H,3H2,1-2H3
InChIKey
QOYINWMUFFDLBI-UHFFFAOYSA-N
Compound name
2-ethyl-2-methyl-1,3-dihydroperimidine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

5
Patents

212.13135 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.138626 150.4
[M+Na]+ 235.120568 158.6
[M-H]- 211.124074 149.5
[M+NH4]+ 230.165173 169.6
[M+K]+ 251.094508 152.4
[M+H-H2O]+ 195.128610 142.8
[M+HCOO]- 257.129551 164.5
[M+CH3COO]- 271.145201 161.1
[M+Na-2H]- 233.106016 159.2
[M]+ 212.13080142 147.0
[M]- 212.13189858 147.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe